Data quality metrics extracted from 8oqj.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.2",
  "uuid": "ab55d3e8ab37d90ffe70e4d1d5609cd8",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 33.576,
    "b": 37.831,
    "c": 37.834,
    "alpha": 100.390,
    "beta": 114.386,
    "gamma": 101.179
  },
  "wavelengths": [0.99987],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [35.5,1.64],
    "number_observations_unique": 18881,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.064
      },
      {
        "type": "R(meas)",
        "value": 0.076
      },
      {
        "type": "R(pim)",
        "value": 0.04
      },
      {
        "type": "I/SigI",
        "value": 10.8
      },
      {
        "type": "Completeness",
        "value": 96.34
      },
      {
        "type": "Redundancy",
        "value": 3.5
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.7,1.64],
      "number_observations_unique": 1783,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.742
        },
        {
          "type": "Completeness",
          "value": 90.46
        }
      ]
    }
  ]

}
  

Table 1 generated from MXLIMS-JSON (via JavaScript):


Binned data generated from MXLIMS-JSON (via JavaScript):